3-bromanyl-N-(2-cyanoethyl)-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-bromanyl-N-(2-cyanoethyl)-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-bromo-N-(2-cyanoethyl)benzenesulfonamide CAS Name: 3-bromo-N-(2-cyanoethyl)-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-bromo-N-(2-cyanoethyl)benzenesulfonamide Traditional Name: N-benzyl-3-bromo-N-(2-cyanoethyl)benzenesulfonamide Formula: C16H15BrN2O2S MolecularWeight: 379.2715

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC#N)S(=O)(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC#N)S(=O)(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C16H15BrN2O2S/c17-15-8-4-9-16(12-15)22(20,21)19(11-5-10-18)13-14-6-2-1-3-7-14/h1-4,6-9,12H,5,11,13H2